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Details

Stereochemistry ABSOLUTE
Molecular Formula C22H30O4
Molecular Weight 358.4712
Optical Activity UNSPECIFIED
Defined Stereocenters 7 / 7
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 17,21-DIHYDROXY-16.BETA.-METHYLPREGNA-1,4-DIENE-3,20-DIONE

SMILES

[H][C@@]12C[C@H](C)[C@](O)(C(=O)CO)[C@@]1(C)CC[C@@]3([H])[C@@]2([H])CCC4=CC(=O)C=C[C@]34C

InChI

InChIKey=OPANQAGTORONNC-OHIZPDRYSA-N
InChI=1S/C22H30O4/c1-13-10-18-16-5-4-14-11-15(24)6-8-20(14,2)17(16)7-9-21(18,3)22(13,26)19(25)12-23/h6,8,11,13,16-18,23,26H,4-5,7,9-10,12H2,1-3H3/t13-,16+,17-,18-,20-,21-,22-/m0/s1

HIDE SMILES / InChI

Molecular Formula C22H30O4
Molecular Weight 358.4712
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 7 / 7
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 06:29:51 UTC 2023
Edited
by admin
on Sat Dec 16 06:29:51 UTC 2023
Record UNII
6909Q60UM0
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
17,21-DIHYDROXY-16.BETA.-METHYLPREGNA-1,4-DIENE-3,20-DIONE
Systematic Name English
PREGNA-1,4-DIENE-3,20-DIONE, 17,21-DIHYDROXY-16-METHYL-, (16.BETA.)-
Systematic Name English
BETAMETHASONE IMPURITY J [EP IMPURITY]
Common Name English
Code System Code Type Description
EPA CompTox
DTXSID00171486
Created by admin on Sat Dec 16 06:29:51 UTC 2023 , Edited by admin on Sat Dec 16 06:29:51 UTC 2023
PRIMARY
CAS
18383-24-9
Created by admin on Sat Dec 16 06:29:51 UTC 2023 , Edited by admin on Sat Dec 16 06:29:51 UTC 2023
PRIMARY
FDA UNII
6909Q60UM0
Created by admin on Sat Dec 16 06:29:51 UTC 2023 , Edited by admin on Sat Dec 16 06:29:51 UTC 2023
PRIMARY
PUBCHEM
22819726
Created by admin on Sat Dec 16 06:29:51 UTC 2023 , Edited by admin on Sat Dec 16 06:29:51 UTC 2023
PRIMARY
Related Record Type Details
PARENT -> IMPURITY
CHROMATOGRAPHIC PURITY (HPLC/UV)
EP